1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

C18H24N4O3 — CID 8530807

IUPAC1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(CC(=O)Nc2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C18H24N4O3/c19-17(24)12-7-9-22(10-8-12)11-16(23)21-15-4-2-1-3-14(15)18(25)20-13-5-6-13/h1-4,12-13H,5-11H2,(H2,19,24)(H,20,25)(H,21,23)
InChIKeyAZHZNGOTCBGRGG-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.71
Rot. Bonds6

About 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide (PubChem CID 8530807) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide
PubChem CID8530807
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(CC(=O)Nc2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C18H24N4O3/c19-17(24)12-7-9-22(10-8-12)11-16(23)21-15-4-2-1-3-14(15)18(25)20-13-5-6-13/h1-4,12-13H,5-11H2,(H2,19,24)(H,20,25)(H,21,23)
InChIKeyAZHZNGOTCBGRGG-UHFFFAOYSA-N
XLogP0.71
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[(2-morpholin-4-ylacetyl)amino]benzamide
CID 2697520
2-[[2-[4-(2-chlorophenyl)piperazin-1-yl]acetyl]amino]-N-cyclopropylbenzamide
CID 8704585
1-[2-oxo-2-[2-[[(1R)-1-phenylethyl]carbamoyl]anilino]ethyl]piperidine-4-carboxamide
CID 8530568
1-[2-oxo-2-[2-[[(1S)-1-phenylethyl]carbamoyl]anilino]ethyl]piperidine-4-carboxamide
CID 8530563
N-cyclopentyl-2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]benzamide
CID 8688467
1-[2-(2-cyanoanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 799678
2-[3-(azocan-1-yl)propanoylamino]-N-cyclopropylbenzamide
CID 24588779
N-[1-[2-(2-benzoylanilino)-2-oxoethyl]piperidin-4-yl]-4-fluorobenzamide
CID 34791543
1-[2-(2-nitroanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 2919057
2-[[2-[4-(hydroxymethyl)piperidin-1-yl]acetyl]amino]benzamide
CID 60968756
methyl 2-(4-chlorophenyl)-2-[4-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperazin-1-yl]acetate
CID 46444215
N-cyclopropyl-2-[[2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]acetyl]amino]benzamide
CID 17480349

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide (CID 8530807) is 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide is NC(=O)C1CCN(CC(=O)Nc2ccccc2C(=O)NC2CC2)CC1.
What is the InChIKey of 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide?
The InChIKey is AZHZNGOTCBGRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c19-17(24)12-7-9-22(10-8-12)11-16(23)21-15-4-2-1-3-14(15)18(25)20-13-5-6-13/h1-4,12-13H,5-11H2,(H2,19,24)(H,20,25)(H,21,23).
What are the key properties of 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide?
1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 0.71, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide is sourced from PubChem (CID 8530807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).